2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone

C11H17F3N2O2 — CID 130948486

IUPAC2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone
SMILESO=C(N1CCCC(N2CCOCC2)C1)C(F)(F)F
InChIInChI=1S/C11H17F3N2O2/c12-11(13,14)10(17)16-3-1-2-9(8-16)15-4-6-18-7-5-15/h9H,1-8H2
InChIKeyOUQCTWCSIWJJHN-UHFFFAOYSA-N
MW266.26 g/mol
LogP0.87
Rot. Bonds1

About 2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone

2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone (PubChem CID 130948486) has the molecular formula C11H17F3N2O2 and a molecular weight of 266.26 g/mol. Its IUPAC name is 2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone
PubChem CID130948486
Molecular FormulaC11H17F3N2O2
Molecular Weight266.26 g/mol
Exact Mass266.12
IUPAC Name2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone
SMILESO=C(N1CCCC(N2CCOCC2)C1)C(F)(F)F
InChIInChI=1S/C11H17F3N2O2/c12-11(13,14)10(17)16-3-1-2-9(8-16)15-4-6-18-7-5-15/h9H,1-8H2
InChIKeyOUQCTWCSIWJJHN-UHFFFAOYSA-N
XLogP0.87
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.26
LogP ≤ 50.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-Fluoropiperidin-1-yl)-2-morpholin-4-ylethanone
CID 172434889
4-(2-Oxo-2-piperidin-1-ylethyl)-2-(trifluoromethyl)morpholine
CID 56864653
3,3,3-Trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)propan-1-one
CID 126460687
5-[(4,4-Difluoropiperidin-1-yl)methyl]morpholin-3-one
CID 25054156
2,2,2-Trifluoro-1-(4-morpholin-4-ylpiperidin-1-yl)ethanone
CID 57979789
1-(3,3-Difluoropiperidin-1-yl)-2-(2,2-dimethylmorpholin-4-yl)ethanone
CID 70869827
1-(4,4-Difluoropiperidin-1-yl)-2-(2,2-dimethylmorpholin-4-yl)ethanone
CID 70906987
4,4,4-Trifluoro-1-(7-methyl-3-oxa-7,9-diazabicyclo[3.3.1]nonan-9-yl)butan-1-one
CID 129269498
4,4,4-Trifluoro-1-(7-propan-2-yl-3-oxa-7,9-diazabicyclo[3.3.1]nonan-9-yl)butan-1-one
CID 140929219
1-[(3R,5R)-3,5-dimethylmorpholin-4-yl]-2-(4-fluoropiperidin-1-yl)ethanone
CID 141160123
1-[4-(Morpholin-4-yl)piperidin-1-yl]ethan-1-one
CID 13398810
N-methyl-2-[4-(2-methylmorpholin-4-yl)piperidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 53606438

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone?
The IUPAC name of 2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone (CID 130948486) is 2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone.
What is the SMILES notation for 2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone?
The canonical SMILES for 2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone is O=C(N1CCCC(N2CCOCC2)C1)C(F)(F)F.
What is the InChIKey of 2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone?
The InChIKey is OUQCTWCSIWJJHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17F3N2O2/c12-11(13,14)10(17)16-3-1-2-9(8-16)15-4-6-18-7-5-15/h9H,1-8H2.
What are the key properties of 2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone?
2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone has a molecular weight of 266.26 g/mol, XLogP of 0.87, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-1-(3-morpholin-4-ylpiperidin-1-yl)ethanone is sourced from PubChem (CID 130948486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).